3-[[2-(4-methylpiperazin-1-yl)phenyl]amino]-4-phenyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[2-(4-methylpiperazin-1-yl)phenyl]amino]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-[2-(4-methylpiperazin-1-yl)anilino]-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[2-(4-methyl-1-piperazinyl)anilino]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-[2-(4-methylpiperazin-1-yl)anilino]-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-[2-(4-methylpiperazino)anilino]-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC3=C(C(=O)C3=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC3=C(C(=O)C3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2/c1-23-11-13-24(14-12-23)17-10-6-5-9-16(17)22-19-18(20(25)21(19)26)15-7-3-2-4-8-15/h2-10,22H,11-14H2,1H3